COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL021024
Chemical Name: propan-2-yl2-({(2E)-2-cyano-3-[5-(3,4-dichlorophenyl)furan-2-yl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(c(c1)Cl)Cl)/C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2

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Molecular Weight: 529.44
Empirical Formula: C26H22Cl2N2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.78
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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